SCHEMBL30360202

SCHEMBL30360202

O=C(c1ccc(Cl)c(Cl)c1)N1CCN(c2ccc([N+](=O)[O-])c(NCc3ccccc3)c2)CC1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.68
ALDH1A1 P00352 8/20 0.68
NPSR1 Q6W5P4 5/20 0.68
CYP3A4 P08684 3/20 0.64
CYP2C9 P11712 3/20 0.64
CYP2C19 P33261 3/20 0.64
CYP1A2 P05177 2/20 0.64
SIRT6 Q8N6T7 1/20 0.63
HTR6 P50406 2/20 0.61
DCTPP1 Q9H773 2/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
HTT P42858 1/20 0.59
LMNA P02545 1/20 0.57
SERPINE1 P05121 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1848710 1.00 MAPT (0.68) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1844755 0.93 MAPT (0.66) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1843205 0.90 MAPT (0.82) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1840598 0.89 MAPT (0.71) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1844591 0.87 MAPT (0.73) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1845787 0.87 MAPT (0.73) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1844791 0.87 MAPT (0.81) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1842484 0.87 DCTPP1 (0.72) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1843801 0.86 MAPT (0.70) MAPTALDH1A1NPSR1CYP3A4CYP2C9
SCHEMBL1845809 0.86 DCTPP1 (0.81) MAPTALDH1A1NPSR1CYP3A4CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11568956-B2 Methods for identifying inhibitors of amyloid protein aggregation TREVENTIS CORPORATION (US) 2023-01-31 US disclosed